Glycoside
...
GD054038

Name:
None

Formula:
C14H17O6N2Cl

Smiles:
Cc1cnc(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Cl

Aglycone:
Cc1cnc(C(N)=O)cc1Cl

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 2
HBD: 5 FractionCSP3: 0.54
AlogP: -1.43 Num_rotatable_bonds: 3
MolWt: 332.74 Num_heavy_atoms: 22
TPSA: 132.14 NumAromaticRings: 1

Unique Aglycone
AD27543
Formula: C8H7ON2Cl

Smiles:
Cc1cnc(C(N)=O)cc1Cl
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.14
AlogP: 1.14 Num_rotatable_bonds: 1
MolWt: 170.6 Num_heavy_atoms: 11
TPSA: 55.98 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O